N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide

C26H23NO3 — CID 95180836

IUPACN-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
SMILESCOc1ccc([C@@H](NC(=O)COc2ccc3ccccc3c2)c2ccccc2)cc1
InChIInChI=1S/C26H23NO3/c1-29-23-14-12-21(13-15-23)26(20-8-3-2-4-9-20)27-25(28)18-30-24-16-11-19-7-5-6-10-22(19)17-24/h2-17,26H,18H2,1H3,(H,27,28)/t26-/m0/s1
InChIKeyMJECFTLQGDBBAK-SANMLTNESA-N
MW397.47 g/mol
LogP5.13
Rot. Bonds7

About N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide

N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 95180836) has the molecular formula C26H23NO3 and a molecular weight of 397.47 g/mol. Its IUPAC name is N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
PubChem CID95180836
Molecular FormulaC26H23NO3
Molecular Weight397.47 g/mol
Exact Mass397.17
IUPAC NameN-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
SMILESCOc1ccc([C@@H](NC(=O)COc2ccc3ccccc3c2)c2ccccc2)cc1
InChIInChI=1S/C26H23NO3/c1-29-23-14-12-21(13-15-23)26(20-8-3-2-4-9-20)27-25(28)18-30-24-16-11-19-7-5-6-10-22(19)17-24/h2-17,26H,18H2,1H3,(H,27,28)/t26-/m0/s1
InChIKeyMJECFTLQGDBBAK-SANMLTNESA-N
XLogP5.13
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.47
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
CID 2944649
N-[(S)-(4-chlorophenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
CID 2195570
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 94843861
N-[(4-fluorophenyl)-phenylmethyl]-2-(4-methoxyphenoxy)acetamide
CID 55583125
2-(3-acetylphenoxy)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide
CID 78798600
N-[(2-hydroxynaphthalen-1-yl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
CID 19165242
[2-(benzhydrylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 2592473
N-[(4-methoxyphenyl)-phenylmethyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 53338538
(2R)-N-[(R)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxybutanamide
CID 7373963
2-(4-methoxyphenoxy)-N-[(S)-(2-methylphenyl)-phenylmethyl]acetamide
CID 38020716
2-(3-methoxyphenoxy)-N-(1-naphthalen-2-ylethyl)acetamide
CID 112779282
2-(4-methoxyphenoxy)-N-[(1R)-2-methyl-1-phenylpropyl]acetamide
CID 9050798

Frequently Asked Questions

What is the IUPAC name of N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide (CID 95180836) is N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide is COc1ccc([C@@H](NC(=O)COc2ccc3ccccc3c2)c2ccccc2)cc1.
What is the InChIKey of N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is MJECFTLQGDBBAK-SANMLTNESA-N. The full InChI is InChI=1S/C26H23NO3/c1-29-23-14-12-21(13-15-23)26(20-8-3-2-4-9-20)27-25(28)18-30-24-16-11-19-7-5-6-10-22(19)17-24/h2-17,26H,18H2,1H3,(H,27,28)/t26-/m0/s1.
What are the key properties of N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide?
N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 397.47 g/mol, XLogP of 5.13, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 95180836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).